SCHEMBL577113

SCHEMBL577113

C#CCOC(=O)CC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4678906 0.91 L3MBTL1 (0.41)
SCHEMBL1356929 0.82 L3MBTL1 (0.44)
SCHEMBL15798217 0.81
Butane SCHEMBL379259 0.81 L3MBTL1 (0.50)
SCHEMBL576638 0.81
SCHEMBL27924556 0.81 L3MBTL1 (0.46)
SCHEMBL10011388 0.79 L3MBTL1 (0.49)
SCHEMBL7255120 0.79 GAA (0.65)
SCHEMBL10527889 0.79 NPC1 (0.45)
SCHEMBL4446043 0.79 GSTP1 (0.53)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 565 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240014444-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM BATTERY ZHANGJIAGANG GUOTAI-HUARONG NEW CHEMICAL MATERIALS CO., LTD (CN) 2024-01-11 US claimed
EP-4199168-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM BATTERY Zhangjiagang Guotai-Huarong New Chemical Materials Co., Ltd (CN) 2023-06-21 EP claimed
CN-108140889-B Nonaqueous electrolyte solution and electricity storage device using same 宇部兴产株式会社 2020-12-25 CN claimed
CN-106631895-B Phenoxy phenoxy base propionic acid propargyl ester compound and its preparation method and application 江苏富鼎化学有限公司 2019-03-29 CN claimed
US-20180301758-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2018-10-18 US claimed
CN-108140889-A Nonaqueous electrolytic solution and the electric energy storage device for having used nonaqueous electrolytic solution 宇部兴产株式会社 2018-06-08 CN claimed
CN-106631895-A Phenoxyphenoxylpropargyl propionate compound as well as preparation method and application thereof 江苏富鼎化学有限公司 2017-05-10 CN claimed
EP-2681595-B1 PROCESS FOR PREPARING MOLDED OPTICAL ARTICLES PPG IND OHIO INC (US) 2015-02-18 EP claimed
EP-2559721-B1 Compositions and articles prepared from thioether functional oligomeric polythiols PPG IND OHIO INC (US) 2015-01-07 EP claimed
US-8848288-B2 Composite optical articles PPG INDUSTRIES OHIO, INC. (US) 2014-09-30 US claimed
US-5380852-A Plant safening agents HOECHST AKTIENGESELLSCHAFT (DE) 1995-01-10 US claimed
EP-0389617-B1 TREATMENT OF RHODIUM CATALYSTS UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1993-03-17 EP claimed
EP-0357997-B1 REACTIVATION OF HYDROFORMYLATION CATALYSTS UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (a New York corporation) (US) 1992-11-25 EP claimed
EP-0389617-A1 TREATMENT OF RHODIUM CATALYSTS. UNION CARBIDE CHEM PLASTIC (US) 1990-10-03 EP claimed
US-4929767-A PRETREATING AN ORGANIC SOLUTION OF A DEACTIVATED RHODIUM-PHOSPHINE COMPLEX TO IMPROVE RHODIUM EXTRACTABILITY INTO AN AQUEOUS SOLUTION; REUSE UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (US) 1990-05-29 US claimed
WO-1990003841-A1 TREATMENT OF RHODIUM CATALYSTS UNION CARBIDE CHEMICALS AND PLASTICS COMPANY INC. (US) 1990-04-19 WO claimed
CN-1040746-A The reactivation of carbonylating catalyst UNION CARBIDE CHEM PLASTIC (US) 1990-03-28 CN claimed
CN-1035752-A Plant protectant based on the pyrazole carboxylic acid derivative HOECHST AG (DE) 1989-09-27 CN claimed
US-4861918-A RHODIUM-TERITARY ORGANOPHOSPHINE COMPLEX UNION CARBIDE CORPORATION (US) 1989-08-29 US claimed
CN-86104887-A (R)-2-[4-(5-chloro-3-fluorine pyridine-2-base oxygen) phenoxy group] the propionic acid propargyl ester the preparation method and as herbicide applications 1987-12-23 CN claimed